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Author Topic: How to simulate the oxidation process of Al using a ReaxFF Potential  (Read 1539 times)

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Offline wyh

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How to simulate the oxidation process of Al using a ReaxFF Potential
« on: August 26, 2016, 15:08 »
PLS
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Offline Jess Wellendorff

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Re: How to simulate the oxidation process of Al using a ReaxFF Potential
« Reply #1 on: August 29, 2016, 09:04 »
Perhaps you are looking for something like this: http://pubs.acs.org/doi/abs/10.1021/acs.jpcc.5b04650
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